(Q27126021)

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestanoyl-CoA (English)

retrieved

6 October 2016

isomeric SMILES

C[C@H](CCC[C@@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)([O-])[O-])O)[C@H]4CC[C@@H]5[C@@]4(CC[C@H]6[C@H]5[C@@H](C[C@H]7[C@@]6(CC[C@H](C7)O)C)O)C

1 reference

InChI=1S/C48H80N7O19P3S/c1-26(30-10-11-31-36-32(13-16-48(30,31)6)47(5)15-12-29(56)20-28(47)21-33(36)57)8-7-9-27(2)45(62)78-19-18-50-35(58)14-17-51-43(61)40(60)46(3,4)23-71-77(68,69)74-76(66,67)70-22-34-39(73-75(63,64)65)38(59)44(72-34)55-25-54-37-41(49)52-24-53-42(37)55/h24-34,36,38-40,44,56-57,59-60H,7-23H2,1-6H3,(H,50,58)(H,51,61)(H,66,67)(H,68,69)(H2,49,52,53)(H2,63,64,65)/p-4/t26-,27-,28+,29-,30-,31+,32+,33-,34-,36+,38-,39-,40+,44-,47+,48-/m1/s1

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestanoyl-CoA (English)

retrieved

6 October 2016

Identifiers

InChI

1 reference

based on heuristic

inferred from SMILES

InChIKey

SBYLHTNKEWSLBA-NOMRFMDASA-J

2 references

(25R)-3alpha,7alpha-dihydroxy-5beta-cholestanoyl-CoA (English)

retrieved

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

Adenosine, 5'-O-[[[[(3R)-4-[[3-[[2-[[(3alpha,5beta,7alpha,25R)-3,7-dihydroxy-26-oxocholestan-26-yl]thio]ethyl]amino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]hydroxyphosphinyl]oxy]hydroxy (English)

6 October 2016

1 reference